alpha-elemol
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :2-[(1R,3S,4S)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl]propan-2-ol
InChI :InChI=1/C15H26O/c1-7-15(6)9-8-12(14(4,5)16)10-13(15)11(2)3/h7,12-13,16H,1-2,8-10H2,3-6H3/t12-,13+,15-/m1/s1
InChIKey :GFJIQNADMLPFOW-VNHYZAJKBC
SMILES :CC(=C)[C@@H]1C[C@@H](CC[C@@]1(C)C=C)C(C)(C)O
(EINECS) number :211-360-5
cas number :639-99-6
coe number :10205
fl. number :02.149
molar refractivity :71.53 ± 0.3 cm3
parachor :581.3 ± 6.0 cm3
index of refraction :1.511 ± 0.02
surface tension :35.3 ± 3.0 dyne/cm
density :0.932 ± 0.06 g/cm3
polarizability :28.35 ± 0.5 10-24cm3
xlogp : 4.70
molecular weight : 222.3663400
formula :C15 H26 O
 
 
fda reg :unspecified h. number :unspecified
organoleptics : 
odor strength :medium
odor description :
at 100.00 %.  
green woody sweet
properties : 
appearence :pale yellow to yellow crystals or solid
assay : 95.00 - 100.00 %   
Food Chemicals Codex Listed :No
melting point : 51.00 - 52.00 °C. @ 760.00 mm Hg
boiling point : 144.00 - 145.00 °C. @ 15.00 mm Hg
logp : 4.75
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 210.00  °F.  TCC  ( 98.89 °C. )
  
recommendation for alpha-elemol usage levels up to :
  4.0000 % in the fragrance concentrate.
  
safety links : 
(EINECS) number :211-360-5
chemidplus :000639996
epa-srs :639-99-6
  
other : 
 
references : 
fl. number :02.149
pubchem :668984
  
synonyms :
alpha,alpha-dimethyl vinyl-ortho-menthene methanol
(1S,2S,4R)-(-)-alpha,alpha-dimethyl-1-vinyl-ortho-menth-8-ene-4-methanol
(-)-elemol
alpha-elemol
soluble in :
 alcohol
 water, very slightly
insoluble in :
 water
natural occurrence in :
citronella oil java
elemi oil manila
grapefruit juice



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